1-methyl-4-piperidin-1-ylsulfonyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-piperidin-1-ylsulfonyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrole-2-carboxamide Openeye Name: 1-methyl-4-(1-piperidylsulfonyl)-N-(5-thioxo-1H-1,2,4-triazol-4-yl)pyrrole-2-carboxamide CAS Name: 1-methyl-4-(1-piperidinylsulfonyl)-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-piperidin-1-ylsulfonyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrole-2-carboxamide Traditional Name: 1-methyl-4-piperidinosulfonyl-N-(5-thioxo-1H-1,2,4-triazol-4-yl)pyrrole-2-carboxamide Formula: C13H18N6O3S2 MolecularWeight: 370.45042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NN2C=NNC2=S)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)NN2C=NNC2=S)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C13H18N6O3S2/c1-17-8-10(24(21,22)18-5-3-2-4-6-18)7-11(17)12(20)16-19-9-14-15-13(19)23/h7-9H,2-6H2,1H3,(H,15,23)(H,16,20)